CHEBI:85213 - 16-hydroxyhexadecanoyl-CoA

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ChEBI Name 16-hydroxyhexadecanoyl-CoA
ChEBI ID CHEBI:85213
Definition An ω-hydroxy fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 16-hydroxyhexadecanoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C37H66N7O18P3S
Net Charge 0
Average Mass 1021.94200
Monoisotopic Mass 1021.33979
InChI InChI=1S/C37H66N7O18P3S/c1-37(2,32(49)35(50)40-18-17-27(46)39-19-21-66-28(47)16-14-12-10-8-6-4-3-5-7-9-11-13-15-20-45)23-59-65(56,57)62-64(54,55)58-22-26-31(61-63(51,52)53)30(48)36(60-26)44-25-43-29-33(38)41-24-42-34(29)44/h24-26,30-32,36,45,48-49H,3-23H2,1-2H3,(H,39,46)(H,40,50)(H,54,55)(H,56,57)(H2,38,41,42)(H2,51,52,53)/t26-,30-,31-,32+,36-/m1/s1
InChIKey ROZGNNDROQHXPF-BBECNAHFSA-N
SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCCCCCCCCCCCCCO
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) See: PubMed
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 16-hydroxyhexadecanoyl-CoA (CHEBI:85213) has functional parent 16-hydroxyhexadecanoic acid (CHEBI:55328)
16-hydroxyhexadecanoyl-CoA (CHEBI:85213) has role plant metabolite (CHEBI:76924)
16-hydroxyhexadecanoyl-CoA (CHEBI:85213) is a ω-hydroxy fatty acyl-CoA (CHEBI:85212)
16-hydroxyhexadecanoyl-CoA (CHEBI:85213) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348)
16-hydroxyhexadecanoyl-CoA (CHEBI:85213) is a long-chain fatty acyl-CoA (CHEBI:33184)
16-hydroxyhexadecanoyl-CoA (CHEBI:85213) is conjugate acid of 16-hydroxyhexadecanoyl-CoA(4−) (CHEBI:84207)
Incoming 16-hydroxyhexadecanoyl-CoA(4−) (CHEBI:84207) is conjugate base of 16-hydroxyhexadecanoyl-CoA (CHEBI:85213)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(16-hydroxyhexadecanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
16-hydroxyhexadecanoyl-coenzyme A ChEBI
16-hydroxypalmitoyl-CoA ChEBI
16-hydroxypalmitoyl-coenzyme A ChEBI
Registry Number Type Source
11195626 Reaxys Registry Number Reaxys
Citation
Kim SS, Grienenberger E, Lallemand B, Colpitts CC, Kim SY, Souza Cde A, Geoffroy P, Heintz D, Krahn D, Kaiser M, Kombrink E, Heitz T, Suh DY, Legrand M, Douglas CJ (2010)
LAP6/POLYKETIDE SYNTHASE A and LAP5/POLYKETIDE SYNTHASE B encode hydroxyalkyl α-pyrone synthases required for pollen development and sporopollenin biosynthesis in Arabidopsis thaliana.
The Plant cell 22, 4045-4066 [PubMed:21193570]
[show Abstract]
Last Modified
31 March 2015